2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine

C209H156F6N24O10 — CID 159148825

IUPAC2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
SMILESCC1(C)c2cc(-c3cccc(-c4nc5ncccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5ncccc5o4)c3)cc21.CCCCCCC1(CCCCCC)c2cc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)cc21.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C(F)(F)F)(C(F)(F)F)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)c6)ccc4-5)c3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1
InChIInChI=1S/C51H50N4O2.C41H30N4O2.C39H22F6N6O2.C39H28N6O2.C39H26N4O2/c1-5-7-9-11-27-51(28-12-10-8-6-2)43-31-37(35-15-13-17-39(29-35)49-54-47-45(56-49)25-19-33(3)52-47)21-23-41(43)42-24-22-38(32-44(42)51)36-16-14-18-40(30-36)50-55-48-46(57-50)26-20-34(4)53-48;1-23-11-17-35-37(42-23)44-39(46-35)29-9-5-7-25(19-29)27-13-15-31-32-16-14-28(22-34(32)41(3,4)33(31)21-27)26-8-6-10-30(20-26)40-45-38-36(47-40)18-12-24(2)43-38;1-19-9-15-31-33(46-19)50-35(52-31)29-7-3-5-27(48-29)21-11-13-23-24-14-12-22(18-26(24)37(25(23)17-21,38(40,41)42)39(43,44)45)28-6-4-8-30(49-28)36-51-34-32(53-36)16-10-20(2)47-34;1-21-11-17-33-35(40-21)44-37(46-33)31-9-5-7-29(42-31)23-13-15-25-26-16-14-24(20-28(26)39(3,4)27(25)19-23)30-8-6-10-32(43-30)38-45-36-34(47-38)18-12-22(2)41-36;1-39(2)31-21-25(23-7-3-9-27(19-23)37-42-35-33(44-37)11-5-17-40-35)13-15-29(31)30-16-14-26(22-32(30)39)24-8-4-10-28(20-24)38-43-36-34(45-38)12-6-18-41-36/h13-26,29-32H,5-12,27-28H2,1-4H3;5-22H,1-4H3;3-18H,1-2H3;5-20H,1-4H3;3-22H,1-2H3
InChIKeyKJADVHCGCNUODN-UHFFFAOYSA-N
MW3277.69 g/mol
LogP53.70
Rot. Bonds30

About 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine

2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 159148825) has the molecular formula C209H156F6N24O10 and a molecular weight of 3277.69 g/mol. Its IUPAC name is 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
PubChem CID159148825
Molecular FormulaC209H156F6N24O10
Molecular Weight3277.69 g/mol
Exact Mass3275.23
IUPAC Name2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
SMILESCC1(C)c2cc(-c3cccc(-c4nc5ncccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5ncccc5o4)c3)cc21.CCCCCCC1(CCCCCC)c2cc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)cc21.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C(F)(F)F)(C(F)(F)F)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)c6)ccc4-5)c3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1
InChIInChI=1S/C51H50N4O2.C41H30N4O2.C39H22F6N6O2.C39H28N6O2.C39H26N4O2/c1-5-7-9-11-27-51(28-12-10-8-6-2)43-31-37(35-15-13-17-39(29-35)49-54-47-45(56-49)25-19-33(3)52-47)21-23-41(43)42-24-22-38(32-44(42)51)36-16-14-18-40(30-36)50-55-48-46(57-50)26-20-34(4)53-48;1-23-11-17-35-37(42-23)44-39(46-35)29-9-5-7-25(19-29)27-13-15-31-32-16-14-28(22-34(32)41(3,4)33(31)21-27)26-8-6-10-30(20-26)40-45-38-36(47-40)18-12-24(2)43-38;1-19-9-15-31-33(46-19)50-35(52-31)29-7-3-5-27(48-29)21-11-13-23-24-14-12-22(18-26(24)37(25(23)17-21,38(40,41)42)39(43,44)45)28-6-4-8-30(49-28)36-51-34-32(53-36)16-10-20(2)47-34;1-21-11-17-33-35(40-21)44-37(46-33)31-9-5-7-29(42-31)23-13-15-25-26-16-14-24(20-28(26)39(3,4)27(25)19-23)30-8-6-10-32(43-30)38-45-36-34(47-38)18-12-22(2)41-36;1-39(2)31-21-25(23-7-3-9-27(19-23)37-42-35-33(44-37)11-5-17-40-35)13-15-29(31)30-16-14-26(22-32(30)39)24-8-4-10-28(20-24)38-43-36-34(45-38)12-6-18-41-36/h13-26,29-32H,5-12,27-28H2,1-4H3;5-22H,1-4H3;3-18H,1-2H3;5-20H,1-4H3;3-22H,1-2H3
InChIKeyKJADVHCGCNUODN-UHFFFAOYSA-N
XLogP53.70
TPSA440.76 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds30
Heavy Atoms249
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003277.69
LogP ≤ 553.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine with MolForge

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Related Compounds

5-Methyl-2-[3-[7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine
CID 59738972
5-Methyl-2-[6-methyl-5-[7-[2-methyl-6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)pyridin-3-yl]-9,9-bis(trifluoromethyl)fluoren-2-yl]pyridin-2-yl]-[1,3]oxazolo[4,5-b]pyridine
CID 59738979
5-Methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)pyridin-2-yl]-9,9-bis(trifluoromethyl)fluoren-2-yl]pyridin-2-yl]-[1,3]oxazolo[4,5-b]pyridine
CID 59738980
5-Methyl-2-[3-[7-[3-(5-methyl-6,7-dihydro-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine
CID 88983143
2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-5-[4-[(3E)-hexa-1,3,5-trien-3-yl]phenyl]-4-phenyl-1,2,4-triazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-[1,1-dimethyl-3,4-diphenyl-5-(6-phenyl-2-pyridinyl)silol-2-yl]-6-pyridin-2-ylpyridine;1,1-dimethyl-2,3,4,5-tetraphenylsilole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole
CID 158093473
N,N-bis[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;tris(platinum(2+))
CID 158282275
2-[4-[9,9-Dihexyl-7-[4-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[5-[9,9-dimethyl-7-[2-methyl-6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]fluoren-2-yl]-6-methyl-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[4-[9,9-dimethyl-7-[4-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[4-[9,9-dimethyl-7-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-methyl-5-[7-[2-methyl-6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
CID 158312442
CID 158792617
CID 158792617
CID 159377111
CID 159377111
2-(2-acetylphenyl)-7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;2-(2,2-difluoro-1,3-dihydroinden-4-yl)-7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;2-[2-(difluoromethoxy)-3-pyridinyl]-7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-2-[2-(trifluoromethoxy)phenyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 159968382
CID 160519109
CID 160519109
2-(4-Tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-2-pyridinyl)silol-2-yl]-6-pyridin-2-ylpyridine;1,1-dimethyl-2,3,4,5-tetraphenylsilole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-[[4-[4-(3-methylphenyl)cyclopenta-1,3-dien-1-yl]phenyl]-bis[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazole;trimethyl-[3-[10-(3-methylphenyl)-7,7-diphenyl-3,11-disilatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]phenyl]silane
CID 160548067

Frequently Asked Questions

What is the IUPAC name of 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine (CID 159148825) is 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine is CC1(C)c2cc(-c3cccc(-c4nc5ncccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5ncccc5o4)c3)cc21.CCCCCCC1(CCCCCC)c2cc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)ccc2-c2ccc(-c3cccc(-c4nc5nc(C)ccc5o4)c3)cc21.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C(F)(F)F)(C(F)(F)F)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)c6)ccc4-5)c3)nc2n1.Cc1ccc2oc(-c3cccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6cccc(-c7nc8nc(C)ccc8o7)n6)ccc4-5)n3)nc2n1.
What is the InChIKey of 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is KJADVHCGCNUODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H50N4O2.C41H30N4O2.C39H22F6N6O2.C39H28N6O2.C39H26N4O2/c1-5-7-9-11-27-51(28-12-10-8-6-2)43-31-37(35-15-13-17-39(29-35)49-54-47-45(56-49)25-19-33(3)52-47)21-23-41(43)42-24-22-38(32-44(42)51)36-16-14-18-40(30-36)50-55-48-46(57-50)26-20-34(4)53-48;1-23-11-17-35-37(42-23)44-39(46-35)29-9-5-7-25(19-29)27-13-15-31-32-16-14-28(22-34(32)41(3,4)33(31)21-27)26-8-6-10-30(20-26)40-45-38-36(47-40)18-12-24(2)43-38;1-19-9-15-31-33(46-19)50-35(52-31)29-7-3-5-27(48-29)21-11-13-23-24-14-12-22(18-26(24)37(25(23)17-21,38(40,41)42)39(43,44)45)28-6-4-8-30(49-28)36-51-34-32(53-36)16-10-20(2)47-34;1-21-11-17-33-35(40-21)44-37(46-33)31-9-5-7-29(42-31)23-13-15-25-26-16-14-24(20-28(26)39(3,4)27(25)19-23)30-8-6-10-32(43-30)38-45-36-34(47-38)18-12-22(2)41-36;1-39(2)31-21-25(23-7-3-9-27(19-23)37-42-35-33(44-37)11-5-17-40-35)13-15-29(31)30-16-14-26(22-32(30)39)24-8-4-10-28(20-24)38-43-36-34(45-38)12-6-18-41-36/h13-26,29-32H,5-12,27-28H2,1-4H3;5-22H,1-4H3;3-18H,1-2H3;5-20H,1-4H3;3-22H,1-2H3.
What are the key properties of 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine?
2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 3277.69 g/mol, XLogP of 53.70, 30 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[9,9-dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 159148825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).